2-(4-chlorophenyl)sulfonyl-N-hydroxyacetamide

C8H8ClNO4S — CID 2819553

IUPAC2-(4-chlorophenyl)sulfonyl-N-hydroxyacetamide
SMILESO=C(CS(=O)(=O)c1ccc(Cl)cc1)NO
InChIInChI=1S/C8H8ClNO4S/c9-6-1-3-7(4-2-6)15(13,14)5-8(11)10-12/h1-4,12H,5H2,(H,10,11)
InChIKeyGJIBVKBTVHPMIL-UHFFFAOYSA-N
MW249.68 g/mol
LogP0.62
Rot. Bonds3

About 2-(4-chlorophenyl)sulfonyl-N-hydroxyacetamide

2-(4-chlorophenyl)sulfonyl-N-hydroxyacetamide (PubChem CID 2819553) has the molecular formula C8H8ClNO4S and a molecular weight of 249.68 g/mol. Its IUPAC name is 2-(4-chlorophenyl)sulfonyl-N-hydroxyacetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)sulfonyl-N-hydroxyacetamide
PubChem CID2819553
Molecular FormulaC8H8ClNO4S
Molecular Weight249.68 g/mol
Exact Mass248.99
IUPAC Name2-(4-chlorophenyl)sulfonyl-N-hydroxyacetamide
SMILESO=C(CS(=O)(=O)c1ccc(Cl)cc1)NO
InChIInChI=1S/C8H8ClNO4S/c9-6-1-3-7(4-2-6)15(13,14)5-8(11)10-12/h1-4,12H,5H2,(H,10,11)
InChIKeyGJIBVKBTVHPMIL-UHFFFAOYSA-N
XLogP0.62
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.68
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)sulfonyl-N-hydroxyacetamide?
The IUPAC name of 2-(4-chlorophenyl)sulfonyl-N-hydroxyacetamide (CID 2819553) is 2-(4-chlorophenyl)sulfonyl-N-hydroxyacetamide.
What is the SMILES notation for 2-(4-chlorophenyl)sulfonyl-N-hydroxyacetamide?
The canonical SMILES for 2-(4-chlorophenyl)sulfonyl-N-hydroxyacetamide is O=C(CS(=O)(=O)c1ccc(Cl)cc1)NO.
What is the InChIKey of 2-(4-chlorophenyl)sulfonyl-N-hydroxyacetamide?
The InChIKey is GJIBVKBTVHPMIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClNO4S/c9-6-1-3-7(4-2-6)15(13,14)5-8(11)10-12/h1-4,12H,5H2,(H,10,11).
What are the key properties of 2-(4-chlorophenyl)sulfonyl-N-hydroxyacetamide?
2-(4-chlorophenyl)sulfonyl-N-hydroxyacetamide has a molecular weight of 249.68 g/mol, XLogP of 0.62, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)sulfonyl-N-hydroxyacetamide is sourced from PubChem (CID 2819553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).